Glycoside
GD095227
Name:
NoneFormula:
C22H37O9N3Smiles:
C[C@@H]1O[C@@H](OCCNC(=O)[C@@H]2CNC(=O)C23CCN(C(=O)OC(C)(C)C)CC3)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NCC2C(=O)NCCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.86 |
| AlogP: | -1.29 | Num_rotatable_bonds: | 5 |
| MolWt: | 487.55 | Num_heavy_atoms: | 34 |
| TPSA: | 166.89 | NumAromaticRings: | 0 |
Unique Aglycone
AD40647
Formula: C16H27O5N3
Smiles:
CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NCC2C(=O)NCCO| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.81 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 3 |
| MolWt: | 341.41 | Num_heavy_atoms: | 24 |
| TPSA: | 107.97 | NumAromaticRings: | 0 |
